Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetToll-like receptor 8
LigandBDBM50514816
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1858564 (CHEMBL4359293)
IC50 600±n/a nM
Citation Jiang, STanji, HYin, KZhang, SSakaniwa, KHuang, JYang, YLi, JOhto, UShimizu, TYin, H Rationally Designed Small-Molecule Inhibitors Targeting an Unconventional Pocket on the TLR8 Protein-Protein Interface. J Med Chem63:4117-4132 (2020) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Toll-like receptor 8
Name:Toll-like receptor 8
Synonyms:CD_antigen: CD288 | TLR8 | TLR8_HUMAN | TRL8
Type:Enzyme
Mol. Mass.:119828.77
Organism:Homo sapiens (Human)
Description:Q9NR97
Residue:1041
Sequence:
MENMFLQSSMLTCIFLLISGSCELCAEENFSRSYPCDEKKQNDSVIAECSNRRLQEVPQT
VGKYVTELDLSDNFITHITNESFQGLQNLTKINLNHNPNVQHQNGNPGIQSNGLNITDGA
FLNLKNLRELLLEDNQLPQIPSGLPESLTELSLIQNNIYNITKEGISRLINLKNLYLAWN
CYFNKVCEKTNIEDGVFETLTNLELLSLSFNSLSHVPPKLPSSLRKLFLSNTQIKYISEE
DFKGLINLTLLDLSGNCPRCFNAPFPCVPCDGGASINIDRFAFQNLTQLRYLNLSSTSLR
KINAAWFKNMPHLKVLDLEFNYLVGEIASGAFLTMLPRLEILDLSFNYIKGSYPQHINIS
RNFSKLLSLRALHLRGYVFQELREDDFQPLMQLPNLSTINLGINFIKQIDFKLFQNFSNL
EIIYLSENRISPLVKDTRQSYANSSSFQRHIRKRRSTDFEFDPHSNFYHFTRPLIKPQCA
AYGKALDLSLNSIFFIGPNQFENLPDIACLNLSANSNAQVLSGTEFSAIPHVKYLDLTNN
RLDFDNASALTELSDLEVLDLSYNSHYFRIAGVTHHLEFIQNFTNLKVLNLSHNNIYTLT
DKYNLESKSLVELVFSGNRLDILWNDDDNRYISIFKGLKNLTRLDLSLNRLKHIPNEAFL
NLPASLTELHINDNMLKFFNWTLLQQFPRLELLDLRGNKLLFLTDSLSDFTSSLRTLLLS
HNRISHLPSGFLSEVSSLKHLDLSSNLLKTINKSALETKTTTKLSMLELHGNPFECTCDI
GDFRRWMDEHLNVKIPRLVDVICASPGDQRGKSIVSLELTTCVSDVTAVILFFFTFFITT
MVMLAALAHHLFYWDVWFIYNVCLAKVKGYRSLSTSQTFYDAYISYDTKDASVTDWVINE
LRYHLEESRDKNVLLCLEERDWDPGLAIIDNLMQSINQSKKTVFVLTKKYAKSWNFKTAF
YLALQRLMDENMDVIIFILLEPVLQHSQYLRLRQRICKSSILQWPDNPKAEGLFWQTLRN
VVLTENDSRYNNMYVDSIKQY
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50514816
n/a
NameBDBM50514816
Synonyms:CHEMBL4468868
TypeSmall organic molecule
Emp. Form.C12H12Cl3N3OS
Mol. Mass.352.667
SMILESCSc1nnc(CCCO)n1-c1ccc(Cl)c(Cl)c1Cl |(26.4,-24.74,;25.78,-26.15,;26.68,-27.4,;28.22,-27.4,;28.7,-28.86,;27.45,-29.77,;27.45,-31.31,;28.79,-32.08,;30.12,-31.31,;31.45,-32.08,;26.21,-28.86,;24.74,-29.34,;23.6,-28.31,;22.13,-28.78,;21.81,-30.29,;20.35,-30.77,;22.96,-31.32,;22.64,-32.83,;24.42,-30.84,;25.57,-31.87,)|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: